ENPP1 inhibitor 43
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Hodoodo CAT#: H208096

CAS#: 2631703-41-6

Description: ENPP1 inhibitor 43 is a novel small molecule for cancer immunotherapy.

Chemical Structure

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ENPP1 inhibitor 43
CAS# 2631703-41-6
Instruction

Theoretical Analysis

Hodoodo Cat#: H208096
Name: ENPP1 inhibitor 43
CAS#: 2631703-41-6
Chemical Formula: C16H18N6O3S
Exact Mass: 374.12
Molecular Weight: 374.420
Elemental Analysis: C, 51.33; H, 4.85; N, 22.45; O, 12.82; S, 8.56

Price and Availability

Size Price Availability Quantity
1mg USD 285 2 Weeks
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Synonym: ENPP1 inhibitor 43; ENPP1 inhibitor 43

IUPAC/Chemical Name: 2-((2-amino-7H-purin-6-yl)thio)-N-(4-hydroxy-3-methoxyphenyl)butanamide

InChi Key: ZDCMJGUVFRHQEH-UHFFFAOYSA-N

InChi Code: InChI=1S/C16H18N6O3S/c1-3-11(14(24)20-8-4-5-9(23)10(6-8)25-2)26-15-12-13(19-7-18-12)21-16(17)22-15/h4-7,11,23H,3H2,1-2H3,(H,20,24)(H3,17,18,19,21,22)

SMILES Code: COC1=CC(NC(C(CC)SC2=NC(N)=NC3=C2NC=N3)=O)=CC=C1O

Appearance: Solid powder

Purity: >98% (or refer to the Certificate of Analysis)

Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility: To be determined

Shelf Life: >2 years if stored properly

Drug Formulation: To be determined

Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code: 2934.99.9001

More Info:

Biological target:
In vitro activity:
In vivo activity:

Preparing Stock Solutions

The following data is based on the product molecular weight 374.42 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Formulation protocol:
In vitro protocol:
In vivo protocol:

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1. Gangar M, Goyal S, Raykar D, Khurana P, Martis AM, Goswami A, Ghoshal I, Patel KV, Nagare Y, Raikar S, Mukherjee A, Cyriac R, Paquin JF, Kulkarni A. Design, synthesis and biological evaluation studies of novel small molecule ENPP1 inhibitors for cancer immunotherapy. Bioorg Chem. 2022 Feb;119:105549. doi: 10.1016/j.bioorg.2021.105549. Epub 2021 Dec 11. PMID: 34929517.
2. Marucci A, Antonucci A, De Bonis C, Mangiacotti D, Scarale MG, Trischitta V, Di Paola R. GALNT2 as a novel modulator of adipogenesis and adipocyte insulin signaling. Int J Obes (Lond). 2019 Dec;43(12):2448-2457. doi: 10.1038/s41366-019-0367-3. Epub 2019 Apr 30. PMID: 31040393.
3. Villa-Bellosta R, González-Parra E, Egido J. Alkalosis and Dialytic Clearance of Phosphate Increases Phosphatase Activity: A Hidden Consequence of Hemodialysis. PLoS One. 2016 Jul 25;11(7):e0159858. doi: 10.1371/journal.pone.0159858. PMID: 27454315; PMCID: PMC4959680.
4. Weedon MN, Shields B, Hitman G, Walker M, McCarthy MI, Hattersley AT, Frayling TM. No evidence of association of ENPP1 variants with type 2 diabetes or obesity in a study of 8,089 U.K. Caucasians. Diabetes. 2006 Nov;55(11):3175-9. doi: 10.2337/db06-0410. PMID: 17065358.